Compound Detail
CHEMBL2164594
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Basic Information
| ChEMBL ID | CHEMBL2164594 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XVWZNBHOIBWEOU-UHFFFAOYSA-N |
2
Targets
6
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
387.5
MW (Da)
4.83
ALogP
3
HBA
1
HBD
44.8
PSA (Ų)
0.68
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 7.13
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 CHEMBL2243 | IC50 | 7.13 | 6.474 | 74.0 | 5 |
| Fatty-acid amide hydrolase 1 CHEMBL3229 | IC50 | 5.18 | 5.18 | 6670.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Fatty-acid amide hydrolase 1 | IC50 | = | 74.0 | nM | 7.13 | Inhibition of human FAAH after 1 hr | 24900385 |
| Fatty-acid amide hydrolase 1 | IC50 | = | 80.0 | nM | 7.1 | Biological Assay: Assay Method 1: T84 frozen pellets (contents of 1-4x15 cm cult... | - |
| Fatty-acid amide hydrolase 1 | IC50 | = | 80.0 | nM | 7.1 | Biological Assay: Assay Method 1: T84 frozen pellets (contents of 1-4x15 cm cult... | - |
| Fatty-acid amide hydrolase 1 | IC50 | = | 3019.95 | nM | 5.52 | Inhibition of human recombinant FAAH expressed in COS7 cells using anandamide as... | 25282655 |
| Fatty-acid amide hydrolase 1 | IC50 | = | 3020.0 | nM | 5.52 | Inhibition of human recombinant FAAH expressed in COS7 cells using anandamide as... | 25282655 |
| Fatty-acid amide hydrolase 1 | IC50 | = | 6670.0 | nM | 5.18 | Inhibition of rat FAAH after 1 hr | 24900385 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24900385 | 10.1021/ml300186g | Fatty-acid amide hydrolase 1 | 2 |
| 25282655 | 10.1016/j.bmc.2014.09.012 | Fatty-acid amide hydrolase 1 | 2 |
| 25282655 | 10.1016/j.bmc.2014.09.012 | Monoglyceride lipase | 1 |
Data from ChEMBL 36 via Core Engine